SCHEMBL14422915

SCHEMBL14422915

CNC(=O)c1cc(Oc2cccc(NC(=O)CC(=O)Nc3cc(C(C)(C)C)on3)c2)ccn1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 15/20 0.68
KDR P35968 2/20 0.68
RET P07949 2/20 0.52
MAPK13 O15264 2/20 0.50
MAPK14 Q16539 2/20 0.50
PLK4 O00444 1/20 0.50
AURKA O14965 1/20 0.50
JAK2 O60674 1/20 0.50
MAP4K4 O95819 1/20 0.50
ABL1 P00519 1/20 0.50
LCK P06239 1/20 0.50
FYN P06241 1/20 0.50
LYN P07948 1/20 0.50
ROS1 P08922 1/20 0.50
SRC P12931 1/20 0.50
RPS6KB1 P23443 1/20 0.50
EPHA2 P29317 1/20 0.50
TYK2 P29597 1/20 0.50
AXL P30530 1/20 0.50
FRK P42685 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14422914 0.91 RAF1 (0.82) RAF1KDRRETMAPK13MAPK14
SCHEMBL3546156 0.86 RAF1 (0.64) RAF1KDRRETMAPK13MAPK14
SCHEMBL3550019 0.82 RAF1 (0.71) RAF1KDRMAPK13MAPK14BRAF
SCHEMBL13234850 0.81 RAF1 (1.00) RAF1KDRRETMAPK13MAPK14
SCHEMBL14422927 0.81 RAF1 (0.65) RAF1KDRRETMAPK13MAPK14
SCHEMBL3474850 0.81 RAF1 (0.76) RAF1KDRRETMAPK13MAPK14
SCHEMBL938160 0.80 RAF1 (0.66) RAF1KDRRETMAPK13MAPK14
SCHEMBL14422924 0.80 KDR (0.75) RAF1KDRRETMAPK13MAPK14
SCHEMBL14422925 0.80 RET (0.58) RAF1KDRRETMAPK13MAPK14
SCHEMBL14422926 0.79 KDR (0.71) RAF1KDRRETMAPK13MAPK14

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070213374-A1 Malonamide Derivatives MERCK PATENT GMBH (DE) 2007-09-13 US disclosed
US-20070213374-A1 Malonamide Derivatives MERCK PATENT GMBH (DE) 2007-09-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070213374-A1 Malonamide Derivatives RAF1, BRAF, ARAF RAF1 1/4885KDR 1261/4885RET 350/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.